N-benzyl-2-(3-oxo-6-{[2-(propan-2-yl)phenoxy]acetyl}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Chemical Structure Depiction of
N-benzyl-2-(3-oxo-6-{[2-(propan-2-yl)phenoxy]acetyl}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
N-benzyl-2-(3-oxo-6-{[2-(propan-2-yl)phenoxy]acetyl}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Compound characteristics
Compound ID: | V018-1810 |
Compound Name: | N-benzyl-2-(3-oxo-6-{[2-(propan-2-yl)phenoxy]acetyl}-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide |
Molecular Weight: | 472.54 |
Molecular Formula: | C28 H28 N2 O5 |
Smiles: | CC(C)c1ccccc1OCC(c1ccc2c(c1)N(CC(NCc1ccccc1)=O)C(CO2)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2401 |
logD: | 4.24 |
logSw: | -4.3693 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.101 |
InChI Key: | DVCQJSBZXVIIEQ-UHFFFAOYSA-N |